Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 9/20 | 0.49 |
| ▸ | CCR5 | P51681 | 3/20 | 0.49 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.48 |
| ▸ | HRH1 | P35367 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.48 |
| ▸ | GLP1R | P43220 | 1/20 | 0.48 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.48 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | CFTR | P13569 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL13043839 | 0.84 | CCR2 (0.50) | CCR2CCR5ADRB2HRH1DRD3 | |
| SCHEMBL5741416 | 0.83 | CCR2 (0.49) | CCR2CCR5ADRB2HRH1DRD3 | |
| SCHEMBL2080677 | 0.81 | CCR2 (0.50) | CCR2CCR5ADRB2HRH1DRD3 | |
| SCHEMBL7106212 | 0.80 | RXFP1 (0.55) | CCR2KDM4ECYP2C19CFTRRXFP1 | |
| SCHEMBL2993504 | 0.79 | CCR2 (0.61) | CCR2CCR5ADRB2HRH1DRD3 | |
| SCHEMBL14014922 | 0.77 | MEN1 (0.50) | CCR2CCR5ADRB2HRH1DRD3 | |
| SCHEMBL2079560 | 0.77 | CCR2 (0.45) | CCR2CCR5ADRB2HRH1DRD3 | |
| SCHEMBL24263353 | 0.73 | MEN1 (0.57) | NPSR1MEN1KMT2AKDM4ESMN1; SMN2 | |
| SCHEMBL12885976 | 0.73 | MEN1 (0.53) | CCR2CCR5NPSR1MEN1KMT2A | |
| SCHEMBL13753370 | 0.73 | CES2 (0.60) | NPSR1KDM4ESMN1; SMN2MRGPRX4CYP1A2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1343751-A2 | CYCLIC DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | BRISTOL-MYERS SQUIBB COMPANY (US) | 2003-09-17 | — | — | EP | disclosed |
| WO-2002060859-A2 | CYCLIC DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | BRISTOL-MYERS SQUIBB COMPANY (US) | 2002-08-08 | — | — | WO | disclosed |